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Sarcosine, N-hexanoyl-, octyl ester
SpectraBase Compound ID 4wa3rQJZPcP
InChI InChI=1S/C17H33NO3/c1-4-6-8-9-10-12-14-21-17(20)15-18(3)16(19)13-11-7-5-2/h4-15H2,1-3H3
InChIKey ZXWZUZMQURKFNG-UHFFFAOYSA-N
Mol Weight 299.5 g/mol
Molecular Formula C17H33NO3
Exact Mass 299.246044 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID BTrpnLXpWbb
Name Sarcosine, N-hexanoyl-, octyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 299.246043924 u
Formula C17H33NO3
InChI InChI=1S/C17H33NO3/c1-4-6-8-9-10-12-14-21-17(20)15-18(3)16(19)13-11-7-5-2/h4-15H2,1-3H3
InChIKey ZXWZUZMQURKFNG-UHFFFAOYSA-N
Molecular Weight 299.455 g/mol
SMILES CCCCCC(N(CC(OCCCCCCCC)=O)C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.981671